4-[2-(azepan-1-yl)-2-oxoethyl]-6-(morpholine-4-sulfonyl)-2H-1,4-benzothiazin-3(4H)-one
Chemical Structure Depiction of
4-[2-(azepan-1-yl)-2-oxoethyl]-6-(morpholine-4-sulfonyl)-2H-1,4-benzothiazin-3(4H)-one
4-[2-(azepan-1-yl)-2-oxoethyl]-6-(morpholine-4-sulfonyl)-2H-1,4-benzothiazin-3(4H)-one
Compound characteristics
| Compound ID: | E589-2109 |
| Compound Name: | 4-[2-(azepan-1-yl)-2-oxoethyl]-6-(morpholine-4-sulfonyl)-2H-1,4-benzothiazin-3(4H)-one |
| Molecular Weight: | 453.58 |
| Molecular Formula: | C20 H27 N3 O5 S2 |
| Smiles: | C1CCCN(CC1)C(CN1C(CSc2ccc(cc12)S(N1CCOCC1)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6329 |
| logD: | 1.6329 |
| logSw: | -2.5724 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 71.962 |
| InChI Key: | FDIXKJFWUFQRRP-UHFFFAOYSA-N |